ETHYL 3-ACETYL-4-OXOPENTANOATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H14O4
Molecular Weight	186.2051
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETHYL 3-ACETYL-4-OXOPENTANOATE

Structure Search

SMILES

CCOC(=O)CC(C(C)=O)C(C)=O

InChI

InChIKey=NKGFIBABDQHCHZ-UHFFFAOYSA-N

InChI=1S/C9H14O4/c1-4-13-9(12)5-8(6(2)10)7(3)11/h8H,4-5H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C9H14O4
Molecular Weight	186.2051
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:08:48 GMT 2023` Edited by `admin` on `Sat Dec 16 09:08:48 GMT 2023`
Record UNII	4GJG1YUM53
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ETHYL 3-ACETYL-4-OXOPENTANOATE

Systematic Name

English

3-ACETYL-4-OXOPENTANOIC ACID ETHYL ESTER

Systematic Name

English

LEVULINIC ACID, 3-ACETYL-, ETHYL ESTER

Common Name

English

J82.803C

Code

English

PENTANOIC ACID, 3-ACETYL-4-OXO-, ETHYL ESTER

Systematic Name

English

ETHYL 3-ACETYLLEVULINATE

Common Name

English

ETHYL .BETA.',.BETA.-DIACETYLPROPIONATE

Common Name

English

Code System Code Type Description

CAS

18835-02-4

Created by admin on Sat Dec 16 09:08:49 GMT 2023 , Edited by admin on Sat Dec 16 09:08:49 GMT 2023

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FDA UNII

4GJG1YUM53

Created by admin on Sat Dec 16 09:08:49 GMT 2023 , Edited by admin on Sat Dec 16 09:08:49 GMT 2023

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EPA CompTox

DTXSID5044863

Created by admin on Sat Dec 16 09:08:49 GMT 2023 , Edited by admin on Sat Dec 16 09:08:49 GMT 2023

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PUBCHEM

87820

Created by admin on Sat Dec 16 09:08:49 GMT 2023 , Edited by admin on Sat Dec 16 09:08:49 GMT 2023

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